Lurasidone Impurity 6
[CAS# 1807983-62-5]

Identification

• Name: Lurasidone Impurity 6
• Synonyms: ((1R,2R)-2-(((3aR,4S,7R,7aS)-1,3-Dioxooctahydro-2H-4,7-methanoisoindol-2-yl)methyl)cyclohexyl)methyl 4-(benzo[d]isothiazol-3-yl)piperazine-1-carboxylate
• Molecular Formula: C₂₉H₃₆N₄O₄S
• Molecular Weight: 536.69
• CAS Registry Number: 1807983-62-5
• SMILES: O=C(OC[C@@H]1CCCC[C@H]1CN1C(=O)[C@H]2[C@H]([C@@H]3C[C@H]2CC3)C1=O)N1CCN(CC1)C1=NSC2=CC=CC=C21

Properties

• Density: 1.3±0.1 g/cm³, Calc.^*
• Index of Refraction: 1.632, Calc.^*
• Boiling Point: 671.1±55.0 °C (760 mmHg), Calc.^*
• Flash Point: 359.7±31.5 °C, Calc.^*

^* Calculated using Advanced Chemistry Development (ACD/Labs) Software.